Product Name

  • Name

    2-PHENOXYPHENYLACETONITRILE

  • EINECS
  • CAS No. 25562-98-5
  • Article Data7
  • CAS DataBase
  • Density 1.123 g/cm3
  • Solubility
  • Melting Point
  • Formula C14H11NO
  • Boiling Point 338.1 °C at 760 mmHg
  • Molecular Weight 209.247
  • Flash Point 142.7 °C
  • Transport Information
  • Appearance
  • Safety
  • Risk Codes R22
  • Molecular Structure Molecular Structure of 25562-98-5 (2-PHENOXYPHENYLACETONITRILE)
  • Hazard Symbols IrritantXi
  • Synonyms Acetonitrile,(o-phenoxyphenyl)- (8CI);2-Phenoxyphenylacetonitrile;
  • PSA 33.02000
  • LogP 3.54498

Benzeneacetonitrile,2-phenoxy- Specification

The Benzeneacetonitrile,2-phenoxy, with the CAS registry number 25562-98-5, is also known as 2-(2-Phenoxyphenyl)acetonitrile. It belongs to the product category of Aromatic Nitriles. This chemical's molecular formula is C14H11NO and molecular weight is 209.24. What's more, its IUPAC name is 2-(2-Phenoxyphenyl)acetonitrile. 

Physical properties about this chemical are: (1)ACD/LogP: 3.44; (2)#of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.44; (4)ACD/LogD (pH 7.4): 3.44; (5)ACD/BCF (pH 5.5): 242.62; (6)ACD/BCF (pH 7.4): 242.62; (7)ACD/KOC (pH 5.5): 1773.13; (8)ACD/KOC (pH 7.4): 1773.13; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 3; (12)Polar Surface Area: 33.02 Å2; (13)Index of Refraction: 1.582; (14)Molar Refractivity: 62.15 cm3; (15)Molar Volume: 186.2 cm3; (16)Polarizability: 24.64×10-24cm3; (17)Surface Tension: 45.3 dyne/cm; (18)Density: 1.123 g/cm3; (19)Flash Point: 142.7 °C; (20)Enthalpy of Vaporization: 58.14 kJ/mol; (21)Boiling Point: 338.1 °C at 760 mmHg; (22)Vapour Pressure: 0.000101 mmHg at 25 °C.

Uses of Benzeneacetonitrile,2-phenoxy: it is used to produce (2-Phenoxy-phenyl)-acetic acid. The reaction occurs with reagent KOH and solvent Ethanol. This reaction will occur on condition of heating.

Uses of Benzeneacetonitrile,2-phenoxy: it is used to produce (2-Phenoxy-phenyl)-acetic acid.

You can still convert the following datas into molecular structure:
(1) SMILES: N#CCc2ccccc2Oc1ccccc1
(2) InChI: InChI=1/C14H11NO/c15-11-10-12-6-4-5-9-14(12)16-13-7-2-1-3-8-13/h1-9H,10H2
(3) InChIKey: PCMQCXFXODBYGN-UHFFFAOYAS

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